methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate

C18H19N3O5 — CID 58575132

IUPACmethyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate
SMILESCOC(=O)c1cc2[nH]c(=O)c3cnc(C4CCOCC4)n3c2cc1OC
InChIInChI=1S/C18H19N3O5/c1-24-15-8-13-12(7-11(15)18(23)25-2)20-17(22)14-9-19-16(21(13)14)10-3-5-26-6-4-10/h7-10H,3-6H2,1-2H3,(H,20,22)
InChIKeyUNTKLFXAKHNWKU-UHFFFAOYSA-N
MW357.37 g/mol
LogP1.87
Rot. Bonds3

About methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate

methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate (PubChem CID 58575132) has the molecular formula C18H19N3O5 and a molecular weight of 357.37 g/mol. Its IUPAC name is methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate.

Molecular Properties

Compound Namemethyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate
PubChem CID58575132
Molecular FormulaC18H19N3O5
Molecular Weight357.37 g/mol
Exact Mass357.13
IUPAC Namemethyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate
SMILESCOC(=O)c1cc2[nH]c(=O)c3cnc(C4CCOCC4)n3c2cc1OC
InChIInChI=1S/C18H19N3O5/c1-24-15-8-13-12(7-11(15)18(23)25-2)20-17(22)14-9-19-16(21(13)14)10-3-5-26-6-4-10/h7-10H,3-6H2,1-2H3,(H,20,22)
InChIKeyUNTKLFXAKHNWKU-UHFFFAOYSA-N
XLogP1.87
TPSA94.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate with MolForge

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Related Compounds

8-(methoxymethyl)-4-oxo-1-(oxolan-3-yl)-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
CID 86701152
1-cyclohexyl-7-(1,3-dihydroisoindole-2-carbonyl)-8-methoxy-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575157
7-(6-methoxy-3,4-dihydro-2H-quinoline-1-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575017
8-cyclopropyl-7-(1,3-dihydroisoindole-2-carbonyl)-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one;hydrochloride
CID 157372122
7-(5-chloro-1,3-dihydroisoindole-2-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 46910392
6-[8-methyl-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carbonyl]-5,7-dihydro-4H-[1,2]oxazolo[5,4-c]pyridin-3-one
CID 58575395
7-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575011
8-methyl-1-(oxan-3-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylic acid
CID 58574974
1-cyclohexyl-N,N-dimethyl-4-oxo-8-(trifluoromethoxy)-5H-imidazo[1,5-a]quinoxaline-7-carboxamide
CID 24990170
7-(5-bromo-2,3-dihydroindole-1-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58574947
7-(7-fluoro-3,4-dihydro-1H-isoquinoline-2-carbonyl)-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575009
7-[2-(hydroxymethyl)-2,3-dihydroindole-1-carbonyl]-8-methyl-1-(oxan-4-yl)-5H-imidazo[1,5-a]quinoxalin-4-one
CID 58575147

Frequently Asked Questions

What is the IUPAC name of methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate?
The IUPAC name of methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate (CID 58575132) is methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate.
What is the SMILES notation for methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate?
The canonical SMILES for methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate is COC(=O)c1cc2[nH]c(=O)c3cnc(C4CCOCC4)n3c2cc1OC.
What is the InChIKey of methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate?
The InChIKey is UNTKLFXAKHNWKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O5/c1-24-15-8-13-12(7-11(15)18(23)25-2)20-17(22)14-9-19-16(21(13)14)10-3-5-26-6-4-10/h7-10H,3-6H2,1-2H3,(H,20,22).
What are the key properties of methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate?
methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate has a molecular weight of 357.37 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 8-methoxy-1-(oxan-4-yl)-4-oxo-5H-imidazo[1,5-a]quinoxaline-7-carboxylate is sourced from PubChem (CID 58575132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).